Computational Data Science Approaches for Materials Conference 2019

This three day conference invites collaboration in machine learning and data science methods to solve materials-related problems.
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For Questions, please contact:  

  • Administrator
  • Kelly Shea
  • Institute for Materials Science
  • (505) 667-9244
  • Email

Hosted by the Institute for Materials Science

Dates:  April 8-10, 2019
Location:  2nd floor, J.R. Oppenheimer Study Center, Los Alamos National Laboratory, Los Alamos, New Mexico, USA
Sponsors:  Los Alamos National Laboratory, Institute for Materials Science

Registration:  Please fill out the following form and email to Kelly Shea at kshea@lanl.gov

Registration Form

Contact:  For questions regarding registration, student travel funding, or general information, please contact Kelly Shea, 505-667-9244, kshea@lanl.gov

Please register early to allow for LANL badging

Poster Link

Call for poster abstracts

 We would like to bring this conference to your attention and encourage postdocs and graduate students to consider submitting a poster abstract. This event will be an opportunity to share research and network with both LANL and external scientists

Abstract Submission deadline: COB March 15

Please contact Kelly Shea (kshea@lanl.gov) and Roxanne Tutchton (rtutchton@lanl.gov) with additional inquires.

 

Our workshop invites people from both the academic and programmatic research with expertise in machine learning and data science methods to solve materials-related problems. This workshop will provide a unique environment for capability reviews of various teams nationwide, and also initiate effective and realistic collaborations between them.

Draft Agenda

Monday, April 8th, 2019

Monday

April 8th

 

MORNING I

Opening Remarks from Associate Laboratory Director (SC)

8:45 am – 9:00 am

Irene Qualters, ALD (SC, LANL)

Session 1A:

Session 1A: Materials Discovery by Design from Electronic Structures using Data-Science

9:00 am – 9:45 am

Andrew Rappe (UPenn)

9:45 am – 10:15 am

Sorelle Friedler (Haverford College)

10:15 am 10:30 am

Jack Shlachter (T-DO, LANL)

10:30 am – 10:45 am

Thom Mason, Director (LANL)

COFFEE BREAK  (10:45 am -10:55 am)

 

Monday

April 8th

 

MORNING II

Session 1B:

Session 1B: Fundamental Understanding of Materials from Electronic Structures for ‘Materials by Design’.

10:55 am – 11:30 am

Arunima Singh (Arizona State)

11:30 am – 11:55 am

Antia Sanchez Botana (Arizona State)

11:55 am - 12:15 pm

Jianxin Zhu (T-4, LANL)

LUNCH BREAK (12:15 pm  - 1:30 pm)

 

Monday

April 8th

 

AFTERNOON I

Session 1C:

Session 1C : Applying Data Driven Approaches for Molecular and Nano-Scale Materials

1:30 pm – 2:15 pm

Subramanian Sankaranarayanan (Argonne)

2:15 pm – 2:40 pm

Sergei Tretiak (T-1, LANL)

2:40 pm 3:00 pm

Alexandrov Boian (T-1, LANL)

COFFEE BREAK  (3:00 pm  - 3:15 pm)

 

Monday

April 8th

 

AFTERNOON II

Session 1D:

Session 1D : Data Driven Methods for Predicting Micro-Structures in Solids and Fluids

3:15 pm – 4:00 pm

Steve Waiching Sun (Columbia)

4:00 pm – 4:25 pm

Juan Saenz (XCP-4, LANL)

4:25 pm 4:45 pm

Arvind Mohan (T-4, LANL)

 

                     4:45 pm – 6:00 pm

POSTER SESSION (will stay up for 3 days in the lobby)

 

Tuesday, April 9th, 2019

Tuesday

April 9th

 

MORNING II

Session 2A:

Session 2A: Data-Science Tools Development for Materials including Databases and Visualization Techniques

8:45 am – 9:30 am

Olexandr Isayev (UNC, Chapel Hill)

9:30 am – 9:55 am

James Ahrens (CCS-7, LANL)

9:55 am - 10:15 am

Mike McKerns (CCS-3, LANL)

COFFEE BREAK  (10:15 am - 10:30 am)

 

Tuesday

April 9th

 

MORNING II

Session 2B:

Session 2B: General Data Science Method Development

10:30 am – 11:15 am

Ying Wai Li (ORNL)

11:15 am – 11:40 am

Christine Anderson-Cook (CCS-6, LANL)

11:40 am - 12:00 pm

Kipton Barros (T-1, LANL)

LUNCH BREAK (12:00 pm - 1:30 pm)

 

 

 

Tuesday

April 9th

 

AFTERNOON I

Session 2C:

Session 2C : Data-Driven Approaches for Materials and Engineering Problems

1:30 pm – 2:15 pm

Congwang Ye (LLNL)

2:15 pm – 2:40 pm

Brian Giera (LLNL)

2:40 pm - 3:00 pm

David Mascarenas (NSEC, LANL)

COFFEE BREAK  (3:00 pm  - 3:15 pm)

 

Tuesday

April 9th

 

AFTERNOON II

Session 2D:

Session 2D : Datamining and Machine Learning to Guide Experiments and Device Technology

3:15 pm – 4:00 pm

Matthew Rever (LLNL)

4:00 pm – 4:25 pm

Ghanshyam Pilania (MST-8, LANL)

4:25 pm - 4:45 pm

Nikolay Makarov (UbiQD)

                         6:30 pm  

      Banquet (Location: TBA)

 

Wednesday, April 10th, 2019

Wednesday

April 10th

 

MORNING II

Session 3A:

Session 3A: Data-Driven Methods for Mechanical and Mesoscale Structural problems of Materials.

8:45 am – 9:30 am

Surya Kalidindi (Georgia Tech)

9:30 am – 9:55 am

Turab Lookman (T-4, LANL)

9:55 am - 10:15 am

Reeju Pokharel (MST-8, LANL)

COFFEE BREAK  (10:15 am -10:30 am)

 

 

 

Wednesday

April 10th

 

MORNING II

Session 3B:

Session 3B: Data-Driven Approach for Radiation-Matter Interaction

10:30 am – 11:15 am

Ricardo Lebensohn (T-3, LANL)

11:15 am – 11:40 am

Hari Viswanathan (EES-16, LANL)

11:40 am - 12:00 pm

Eddy Timmermans (XCP-5, LANL)

LUNCH BREAK (12:00 pm - 1:30 pm)

 

Wednesday

April 10th

 

AFTERNOON

Session 3C:

Session 3C : Data-Driven Approach for High Energetic Materials

1:30 pm – 2:00 pm

Ed Kober (T-1, LANL)

2:00 pm – 2:30 pm

Marc Cawkwell (T-1, LANL)

2:30 pm - 3:00 pm

Chris Biwer (CCS-7, LANL)

COFFEE BREAK  (3:00 pm  - 3:15 pm)

 

Wednesday

April 10th

 

AFTERNOON II

Session 3D:

Session 3D : Data-Driven Approach for Nuclear and Extreme Materials

3:15 pm – 4:00 pm

Bobby Sumpters (ORNL)

4:00 pm – 4:25 pm

Denise Neudecker (XCP-5, LANL)

4:25 pm - 4:45 pm

TBA

End of Agenda

Organizing Committee

Co-chairs
Towfiq Ahmed -  LANL
D.J. Luscher - LANL
Committee members
Alejandro Lopez - LANL
Roxanne Tutchton - LANL